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  • 1
    Electronic Resource
    Electronic Resource
    Springer
    Adsorption 1 (1995), S. 213-231 
    ISSN: 1572-8757
    Keywords: adsorptive separation ; thermal parametric pumping ; modeling ; simulation
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Physics , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Abstract A detailed model for the recuperative parametric pumping is presented. The model includes intraparticle mass transfer resistance, axial diffusion and non-linear equilibrium represented by Langmuir equation. The sensitivity studies shows that process performance strongly increases when cycle time increases and φ B /φ T ratio and particle size decreases. It also shows that bottom and top dead volumes do not influence much the process performance. Evolution of the histories of concentrations and temperatures, the bed performance from cycle to cycle and the bed dynamics at the cyclic steady state have been discussed. The model revealed itself as useful to simulate the behavior of the recuperative parametric pumping process and was applied to predict optimal experimental results for the system phenol-water/Duolite ES-861 (Part II).
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  • 2
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    Adsorption 4 (1998), S. 25-33 
    ISSN: 1572-8757
    Keywords: hydrophobic zeolites ; breakthrough curves ; adsorption ; binary mixtures ; modeling ; overall mass transfer ; roll-up
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Physics , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Abstract Breakthrough curve measurements of SO2 and water vapor were carried out on a number of selected mordenite and pentasil zeolites from their binary and ternary mixtures with CO2 at 50 and 100°C. SO2 capacities of these samples were found to be significantly reduced by the presence of water. Competitive adsorption led to unusually high overshoot peaks of SO2 breakthrough curves. On the other hand, SO2 was found to displace water on the samples with very high silica to alumina ratio. A linear driving force, isothermal model was used to predict the breakthrough curves. Langmuir and extended Langmuir equilibrium models were used to describe the equilibrium properties of water and SO2, respectively. The overall mass transfer resistance obtained from the model was compared to the values calculated from a simplified biporous adsorbent model to shed some light on the adsorption kinetics.
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  • 3
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    Adsorption 4 (1998), S. 361-372 
    ISSN: 1572-8757
    Keywords: dyestuffs ; modeling ; HSDM ; equilibeium ; film diffusion
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Physics , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Abstract A homogeneous solid phase diffusion model (HSDM) has been developed using a computer to predict the performance of a batch adsorber. The computer program utilises a semi-analytical solution for a two resistance model based on external mass transfer and homogeneous solid phase diffusion. The model has been successfully applied to four adsorption systems, namely, the adsorption of AB25, AR114, BB69 and BR22 onto pith. The method produces excellent correlations between experimental and theoretical concentration decay curves in batch adsorbers. The model developed presents a solution using a single solid diffusion coefficient and a single external mass transfer coefficient which are sufficient to characterise the system within a range of initial dye concentration, 25–300 mg · dm3 and solid/liquid ratios (w/v) 0.25–2.
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  • 4
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    Plasma chemistry and plasma processing 3 (1983), S. 163-192 
    ISSN: 1572-8986
    Keywords: RF plasma ; plasma polymerization ; modeling ; theoretical
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract A theoretical model has been developed to describe the deposition of polymer occurring in a capacitatively coupled, low-pressure, RF discharge sustained in ethane. The reaction mechanism chosen for this model assumes that polymer formation is controlled by the formation of free radicals in the plasma and the subsequent reaction of these species at the surface of the electrodes used to sustain the plasma. Convective and diffusive transport is taken to occur in the direction parallel to the electrodes. Diffusive transport perpendicular to the electrodes is considered to be rapid, and hence the gradients in this direction are taken to be negligible. Both the composition of the gas leaving the plasma reactor and the axial profile of polymer deposition rate within the reactor, observed experimentally, are predicted accurately by the model. Results obtained from the model have also been used to estimate the kinetic chain length and degree of unsaturation in the polymer. Both predictions are found to be in reasonable agreement with experimental observations.
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  • 5
    ISSN: 1572-896X
    Keywords: particle population ; fluid mechanics ; flame synthesized aerosols ; CFD ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Physics , Technology
    Notes: Abstract The interaction of fluid mechanics and particle dynamics at the very early stages of flame synthesis largely affects the characteristics of the product powder. Detailed simulations provide a better understanding of these processes, which take place in a few milliseconds, and offer the possibility to influence the product characteristics by intelligent selection of the process parameters. The present paper reports on the simulation of titania powder formation by TiCl4 oxidation in an aerosol flow reactor. A commercially available fluid mechanics code is used for the detailed calculation of the fluid flow and the chemical reaction at non-isothermal conditions. This code is then interfaced with a model for aggregate particle dynamics neglecting the spread of the particle size distribution. The simulation shows the onset of the particle formation in the reactor and calculates the dynamic evolution of the aggregate particle size, number of primary particles per aggregate and the specific surface area throughout the reactor. The presented, newly developed calculation technique allows for the first time the simulation of particle formation processes under the authentic, complex conditions as found in actual aerosol reactors.
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  • 6
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    Plasma chemistry and plasma processing 17 (1997), S. 409-432 
    ISSN: 1572-8986
    Keywords: Plasma torch ; modeling ; laminar and turbulent flow
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract A mathematical 2D representation is developed describing the temperature and the velocity profiles in a DC plasma torch and in the resulting plume. It is based on the resolution of conservation equations using the Simple method after Patankar. In the first part, we illustrate the effects of the turbulence, using, on the one hand, two Prandtl's mixing length models and, on the other hand, a standard k – ε model. We also show the influence of physical parameters like the inlet mass flow rate, the current intensity, and the kind of gas (argon or air) on the characteristics of the plasma. The second part of this study presents a comparison of the model with experimental results encountered in the literature. The profiles obtained at the exit of the torch are compared to the mathematical formulation used as boundary condition by the models taking into account only the plasma jet.
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  • 7
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    Plasma chemistry and plasma processing 17 (1997), S. 433-452 
    ISSN: 1572-8986
    Keywords: Laser Doppler anemometry ; fluidized plasma bed ; particles velocity distribution ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract Laser Doppler anemometry (L.D.A.) is an efficient and nonintrusive technique. Today, improved in its configuration, the L.D.A. has been applied even in flowing plasmas. (1,2) In-flight simultaneous measurements were performed for local density and velocity of particle distribution. The measurements provide an insight into thermal and mass transfer, chemical reactivity, and the distribution of residence times of particles in a plasma fluidized bed. The difficulties of L.D.A. in a plasma fludized bed such as high emission intensity of the plasma torch, high temperature, high particle density, and large distribution of particle granulometry were overcomed in the present investigation. The aims achieved were the characterization of the plasma fluidized bed distribution together with accurate measurements of local particle density and velocity as measured by L.D.A.
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  • 8
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    Plasma chemistry and plasma processing 18 (1998), S. 73-89 
    ISSN: 1572-8986
    Keywords: Thermal plasma ; CVD ; modeling ; liquid precursor ; diamond
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract In this paper, a comprehensive model for thermal plasma chemical vapor deposition (TPCVD) with liquid feedstock injection is documented. The gas flow is assumed to be steady, of a single temperature. Radiation and charged species contributions are excluded, but extensive homogeneous and heterogeneous chemistry is included. The liquid phase is traced by considering individual droplets. Discussion on the model's application to diamond production from acetone in a hydrogen–argon plasma is included. The major conclusions are: (1) Liquid injection possesses a capability to deliver the hydrocarbon precursor directly onto the deposition target. (2) For the case of complete evaporation of the droplet before reaching the substrate, the deposition rate is similar to that obtained with gaseous precursors. (3) The computational results compare well with experimental data. The modeling results can be used to optimize the injection parameters with regard to the deposition rate.
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  • 9
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    Plasma chemistry and plasma processing 18 (1998), S. 189-214 
    ISSN: 1572-8986
    Keywords: Remote PECVD ; silicon dioxide ; modeling ; deposition rate
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract Plasma-enhanced chemical vapor deposition has become one of the most important thin film deposition technologies. To avoid direct plasma exposure the substrates may be placed in the remote region. A carrier gas conveys the plasma energy to the deposition area where the reactions with the monomer molecules take place. For the engineering of such a process the modeling of the achievable deposition rate is of great interest. Among different possibilities semiempirical models provide a fast and easily utilizable tool without intensive computer simulations or the necessity of detailed knowledge about the chemistry involved. From deposition experiments with oxygen and an organosilicon monomer (hexamethyldisiloxane, HMDSO) the remote composite parameter is suggested. It combines microwave power, monomer and carrier gas flow rate, and the distance of the substrate from the plasma source. This parameter was derived from the ratio between atomic oxygen and monomer flow rate. In the parameter range considered the deposition rate is described as well ordered and the energy- and monomer-deficient regions are clearly separated.
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  • 10
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    Plasma chemistry and plasma processing 18 (1998), S. 285-303 
    ISSN: 1572-8986
    Keywords: Fullerenes ; carbon arc ; plasma process ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract A mathematical model of the carbon arc process for the synthesis of fullerenes (C 60 , C 70 ) is developed. The two-dimensional model solves for the velocities, temperature, and total concentration of carbon species. The net emission coefficient method is used for the radiation term. The carbon species conservation equations consider the evaporation of carbon from the anode, cathode surface deposition, and carbon condensation. The thermodynamic and transport properties are calculated as a function of temperature and carbon mass fraction, using the method of Chapman–Enskog. Erosion rates used by the model are determined experimentally. Calculated fields of the velocities, temperatures, carbon mass fraction and current intensity are presented. Comparison is made of the behavior of the arc at 1 and 4 mm interelectrode gaps, and between operation in argon and in helium. The results of simulations provide a justification for the higher yields observed in helium compared to the argon case.
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  • 11
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    Plasma chemistry and plasma processing 18 (1998), S. 325-362 
    ISSN: 1572-8986
    Keywords: Microwave plasma ; diamond deposition ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract One-dimensional transport models of moderate-pressure H 2 and H 2 /CH 4 plasmas obtained in a diamond deposition microwave reactor are presented. These models describe the plasma as a thermochemically nonequilibrium flow with three different energy modes. The solution of the one-dimensional plasma transport equations enabled the estimation of plasma species concentrations and temperatures on the axis of the reactor. As far as pure H 2 plasmas are concerned, results showed that the model predictions of gas and vibration temperatures are in good agreement with experimental measurements. The model also yields a relatively good qualitative prediction of the variations of H-atom mole fraction with the power density absorbed by the plasma. The results obtained for H 2 /CH 4 discharges showed that the model prediction on the variations of H-atom mole fraction with methane percentage in the discharge is in good qualitative agreement with experimental results. They also showed that methane is rapidly converted to acetylene before reaching the discharge zone. The concentrations of neutral hydrocarbon species in the reactor are mainly governed by thermal chemistry. The addition of methane strongly affects the ionization kinetics of the plasma. Three major ions are generally obtained in H 2 /CH 4 plasmas: C 2 H 2 + , C 2 H 3 + , and C 2 H 5 + . The relative predominance of these ions depends on the considered plasma region and on the discharge conditions. The ionic species concentrations are also mainly governed by chemistry, except very near the substrate surface. Finally the use of this transport model along with the surface chemistry model of Goodwin (1) enabled us to estimate the diamond growth rate for several discharge conditions.
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  • 12
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    Plasma chemistry and plasma processing 18 (1998), S. 429-446 
    ISSN: 1572-8986
    Keywords: Pulsed microwave discharge ; plasma ignition ; Ar/CF4 mixture ; plasma processing ; etching ; chemical kinetics ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract The present work deals with a pulsed microwave discharge in an Ar/CF 4 gas mixture under a low pressure (1–10 mbar). The discharge chamber developed has a cylindrical geometry with a coupling window alternatively made of quartz or alumina. The setup allows one to investigate the plasma–wall interactions (here etching of the quartz window) and the ignition process of the pulsed microwave plasma. Microwave pulses with a duration of 50–200 μs and repetition rate between 1 and 10 kHz are typical for the experiments. The space-time behavior of the fluorine number density in the discharge has been investigated experimentally by optical actinometry. The discharge kinetics is modeled using electron-transport parameters and rate coefficients derived from solutions of the Boltzmann equation. Together with the solution of the continuity and electron balance equations and the rate equations describing the production of CF x (x=2, 3, 4) radicals and F atoms, a good agreement between experimental and theoretical data can be achieved.
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  • 13
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    Plasma chemistry and plasma processing 19 (1999), S. 341-362 
    ISSN: 1572-8986
    Keywords: Thermal rf plasma ; modeling ; spectroscopy ; plasma flash evaporation
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract The evaporation process of zirconia powders injected in a thermal rf plasma is investigated. Both model calculations and optical emission spectroscopy are used to study the evaporation behavior. Gas temperatures and velocity distributions are determined numerically from conservation laws and Maxwell equations. The influence of plasma and particle parameters on the thermal history of entrained particles is discussed. Asymmetric Abel inversion is applied to detect asymmetric emission profiles in the plasma source. Spectroscopic measurements reveal that evaporated zirconium is concentrated near the axis of the plasma. Numerical calculations show that line-integrated emission profiles can be used to distinguish the cases of complete and incomplete evaporation. Axial emission profiles confirm that the evaporation zone is shifted upstream of the plasma when smaller precursor particles are used.
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  • 14
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    Plasma chemistry and plasma processing 19 (1999), S. 467-486 
    ISSN: 1572-8986
    Keywords: He-plasma ; excitation spectra ; modeling ; comparison with experiments
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract A collisional-radiative model was used to study the kinetics of an atmospheric pressure helium discharge. The electron kinetics was obtained from a two-term solution of the Boltzmann equation with electron–electron collisions included. The distribution of the helium electronic excited states was compared to measured values and used to calculate excitation temperatures. The results show that a unique value of the excitation temperature cannot be used to characterize the whole electronic states distribution, because the plasma is not in local thermodynamical equilibrium under the conditions considered. Other calculated discharge parameters, such as the electron temperature, the maintenance electric field, the density of metastable atoms in the 2 3 S state, and the ion densities are presented and compared to experimental data when available.
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  • 15
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    Plasma chemistry and plasma processing 19 (1999), S. 445-466 
    ISSN: 1572-8986
    Keywords: Dielectric barrier discharge ; CARS on N2 and NO ; NO reduction ; chemical and vibrational kinetics ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract Dielectric barrier discharges (DBD) with planar- and knife-shaped electrodes are operated in N2O2NO mixtures under a pressure of 20 and 98 kPa. They are excited by means of consecutive unipolar or bipolar high-voltage pulse packages of 10 kV at a pulse repetition rate of 1 and 2 kHz. The rotational and vibrational excitation of N 2 molecules and the reduction of nitric oxide (NO) in the discharge have been investigated using coherent anti-Stokes Raman scattering (CARS) technique. Rotational (gas) temperatures near the room temperature and vibrational temperatures of about 800 K at atmospheric pressure and 1400 K at a pressure of 20 kPa are observed. Therefore, chemical reactions of NO with vibrationally excited N 2 are probably insignificant. One-dimensional kinetic models are developed that balance 35 chemical reactions between 10 species and deliver equations for the population density of excited vibrational levels of N 2 together with a solution of the Boltzmann equation for the electrons. A good agreement between measured vibrational temperatures of N 2 , the concentration of NO, and calculated data is achieved. Modeling of the plasma discharge verifies that a DBD operated with a N2NO mixture reduces the NO content, the simultaneous presence of O 2 , already 1%, is enough to prevent the NO reduction.
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  • 16
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    Journal of science education and technology 8 (1999), S. 3-19 
    ISSN: 1573-1839
    Keywords: levels ; complexity ; simulation ; modeling ; science education ; mathematics education ; dynamic systems ; systems thinking
    Source: Springer Online Journal Archives 1860-2000
    Topics: Natural Sciences in General , Technology
    Notes: Abstract The concept of emergent "levels" (i.e., levels that arise from interactions of objects at lower levels) is fundamental to scientific theory. In this paper, we argue for an expanded role for this concept of levels in science education. We show confusion of levels (and "slippage" between levels) as the source of many of people's deep misunderstandings about patterns and phenomena in the world. These misunderstandings are evidenced not only in students' difficulties in the formal study of science but also in their misconceptions about experiences in their everyday lives. The StarLogo modeling language is designed as a medium for students to build models of multi-leveled phenomena and through these constructions explore the concept of levels. We describe several case studies of students working in StarLogo. The cases illustrate students' difficulties with the concept of levels, and how they can begin to develop richer understandings.
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  • 17
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    Journal of science education and technology 6 (1997), S. 173-191 
    ISSN: 1573-1839
    Keywords: Science education ; educational engineering ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Natural Sciences in General , Technology
    Notes: Abstract In this paper, we present a system for formally characterizing elements of an introductory science class, measuring the performance of a class based on this characterization, and modeling the value of the class based on the measurements. This system allows the iterative improvement of any educational presentation through a model, test, iterate cycle. We propose formal practices involved in iteratively improving an educational experience be called educational engineering.
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  • 18
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    Transport in porous media 35 (1999), S. 49-65 
    ISSN: 1573-1634
    Keywords: modeling ; biodegradation ; microbial transport ; dual-porosity ; kinetics.
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Technology
    Notes: Abstract A mathematical model describing microbial transport and growth in a heterogeneous aquifer domain, composed of overlapping subdomains of high-permeability and low-permeability materials, is developed. Each material is conceptually visualized as a continuum which occupies the entire considered spatial aquifer domain. Based on the assumption that advection in the low-permeability domain is negligible, the mathematical model is solved by using a publically available reactive transport code. The importance of modeling microbial transport and growth in such a dual-porosity system is demonstrated through a hypothetical case study.
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  • 19
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    Transport in porous media 28 (1997), S. 233-251 
    ISSN: 1573-1634
    Keywords: capillary pressure ; conservation equations ; constitutive equations ; liquid water ; modeling ; thermodynamic equilibrium
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Technology
    Notes: Abstract In this paper some considerations are presented about the equations needed to set up a model of the process of heat and mass transfer in porous media. A clear classification is made of the various types of equations used and of their physical meaning. Special attention is paid to the thermodynamic equilibrium equations and to their derivation since they are too often taken for granted. The importance of the various transport mechanisms (of mass and energy) is analyzed and the consequences that can arise when some term is neglected are indicated.
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    Transport in porous media 28 (1997), S. 285-306 
    ISSN: 1573-1634
    Keywords: fissured media ; homogenization ; dual porosity ; modeling ; microstructure ; porous media
    Source: Springer Online Journal Archives 1860-2000
    Topics: Geosciences , Technology
    Notes: Abstract Totally fissured media in which the individual cells are isolated by the fissure system are effectively described by double porosity models with microstructure. Such models contain the geometry of the individual cells in the medium and the flux across their interface with the fissure system which surrounds them. We extend these results to a dual-permeability model which accounts for the secondary flux arising from direct cell-to-cell diffusion within the solid matrix. Homogenization techniques are used to construct a new macroscopic model for the flow of a single phase compressible fluid through a partially fissured medium from an exact but highly singular microscopic model, and it is shown that this macroscopic model is mathematically well posed. Preliminary numerical experiments illustrate differences in the behaviour of solutions to the partially fissured from that of the totally fissured case.
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  • 21
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    Journal of science education and technology 6 (1997), S. 193-211 
    ISSN: 1573-1839
    Keywords: Science education ; educational engineering ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Natural Sciences in General , Technology
    Notes: Abstract This article extends and refines the modeling system presented previously (Stewart, 1997). The initial system was sufficient for the optimization of delivery of education at a departmental level. This system is greatly more powerful, precise, and scientific, and fulfills the role of a modeling system for the research and development of educational practices. The model is applied to two widely diverse educational processes, Student Actions and Do Homework Problem, establishing the formalism and demonstrating its usefulness. The use of a rigorous computational syntax imposes completeness criteria on the modeling itself and uniformity. Experimental definition of the formation process of the patterns allows anyone to introduce new features of a model. This and the uniformity allows the models to become the property of the education community, not merely a single researcher, in the same way that mathematical models allow scientists to utilize and build upon previous research.
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    Journal of science education and technology 6 (1997), S. 297-314 
    ISSN: 1573-1839
    Keywords: Science education ; educational engineering ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Natural Sciences in General , Technology
    Notes: Abstract This paper presents a measurement of the time and resources committed to traditional student actions such as reading and working homework. The perception of the educational value of each basic action for both students and faculty is captured. From this information, basic educational efficiencies are computed for a traditional mechanics course and a non-traditional hands-on Electricity and Magnetism course. The calculations show an allocation of resources in the traditional course which uses the most student time in the least educationally valuable activity. The computed efficiencies also show overseen student note-taking as potentially a very valuable general tool. The techniques presented allow any institution to carry out quantitative educational engineering of their course offerings at the highest level.
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  • 23
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    Plasma chemistry and plasma processing 3 (1983), S. 259-273 
    ISSN: 1572-8986
    Keywords: Electric arcs ; thermal plasmas ; contaminants ; modeling
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology , Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Technology
    Notes: Abstract Plasmas consisting of a high-ionization-potential component mixed with a low-ionization-potential contaminant are common in industrial processes. Modeling results are presented for a sodium-contaminated nitrogen plasma column operating either in a free-burning (low-temperature) mode or operating in a constricted (high-temperature) mode. At sufficiently high plasma temperatures, the behavior is dominated by the high-ionization-potential component's properties. The low-ionization-potential contaminant's properties determine the low-temperature plasma behavior even when the contaminant is present in relatively small quantities.
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    Journal of engineering mathematics 34 (1998), S. 277-300 
    ISSN: 1573-2703
    Keywords: modeling ; supercell storm ; nonlinear ; inertial oscillation ; mesonetwork data.
    Source: Springer Online Journal Archives 1860-2000
    Topics: Mathematics , Technology
    Notes: Abstract The pulsing inertial oscillation (PIO) model is a nonlinear, time-dependent, translating vortex solution of the inviscid, compressible fluid dynamic equations in the middle troposphere. The translation of this vortex during a pulse is strikingly similar to that of a supercell storm – a rotating thunderstorm that can generate tornadoes and hail. Two studies were performed to test the hypothesis that some supercell storms are manifestations of a PIO pulse. The first study applied the model to an intense interior draft whose buoyancy was bounded by a temperature excess of ± 12 K. The peak updraft speed achieved was 41·5 m s−1 and the peak Rossby number was 92·9. The study also pointed to an advanced concept for attaining higher values. The second study applied the PIO model to a supercell storm as a whole and succeeded in replicating its bulk properties, such as mesocylonic circulation, net mass and moisture influxes, and time track. This study also identified a critical feature of the PIO model that could be tested against storm data: The average vertical draft is downward before the turn in the storm track and upward afterwards. In the conventional theory, the average vertical draft is upward from storm inception until dissipation. These differing draft predictions were compared with the best available data, which are surface mesonetwork data. These data were found to support the PIO model. However, surface data alone are not conclusive, and further measurements are warranted.
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    Biotechnology and Bioengineering 47 (1995), S. 609-615 
    ISSN: 0006-3592
    Keywords: Trichoderma reesei ; image analysis ; morphology ; modeling ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The microscopic morphology of Trichoderma reesei QM 9414, growing in submerged culture, was studied by image analysis. The morphology was characterized by the total hyphal length, the total number of tips, the number of actively growing tips, and the length of the main hypha. To describe the growth of a single mycelium a simple model is set-up. The main features of the model are: (1) saturation type kinetics for the tip extension of the individual branches within the mycelium; and (2) random branching with a frequency function, which is proportional to the total hyphal length. The model is used to simulate a population of mycelia, where spore germination is described with a log-normal distribution. From the simulation of the population, the average properties of the mycelia, e.g., the average total hyphal length, are calculated, and by fitting the model to experimental data the model parameters are estimated. Finally, the distribution function with respect to the mycelia properties, that is, number of tips and total hyphal length, is calculated, and it corresponds well with the experimental determination of the distribution function. © 1995 John Wiley & Sons Inc.
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  • 26
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    Biotechnology and Bioengineering 46 (1995), S. 202-217 
    ISSN: 0006-3592
    Keywords: batch process ; steady-stage process ; fermentation ; modeling ; simulation ; ethanol ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The aim of the present study was the development of a general simulation module for fermentation within the framework of existing chemical process simulators. This module has been applied to an industrial plant which produces ethanol from beet molasses and fresh beet juice by Saccharomyces cerevisiae. An unstructured mechanistic model has been developed with kinetic laws that are based on a chemically defined reaction scheme which satisfies stoichiometric constraints. This model can be applied to different culture conditions and takes into account secondary byproducts such as higher alcohols. These byproducts are of prime importance and need to be correctly estimated because a sequence of distillation columns follow the fermentor in the plant. Important measurement campaigns have been performed on the plant to validate the model. Plant operation has been successfully simulated using the same kinetic model for both continuous and fed-batch modes of production. © 1995 John Wiley & Sons, Inc.
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  • 27
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    Biotechnology and Bioengineering 53 (1997), S. 243-252 
    ISSN: 0006-3592
    Keywords: carbon dioxide evolution rate ; mass transfer ; modeling ; biodegradation ; pH ; kinetics ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Respirometry is a precious tool for determining the activity of microbial populations. The measurement of oxygen uptake rate is commonly used but cannot be applied in anoxic or anaerobic conditions or for insoluble substrate. Carbon dioxide production can be measured accurately by gas balance techniques, especially with an on-line infrared analyzer. Unfortunately, in dynamic systems, and hence in the case of short-term batch experiments, chemical and physical transfer limitations for carbon dioxide can be sufficient to make the observed carbon dioxide evolution rate (OCER) deduced from direct gas analysis very different from the biological carbon dioxide evolution rate (CER).To take these transfer phenomena into account and calculate the real CER, a mathematical model based on mass balance equations is proposed. In this work, the chemical equilibrium involving carbon dioxide and the measured pH evolution of the liquid medium are considered. The mass transfer from the liquid to the gas phase is described, and the response time of the analysis system is evaluated.Global mass transfer coefficients (KLa) for carbon dioxide and oxygen are determined and compared to one another, improving the choice of hydrodynamic hypotheses. The equations presented are found to give good predictions of the disturbance of gaseous responses during pH changes.Finally, the mathematical model developed associated with a laboratory-scale reactor, is used successfully to determine the CER in nonstationary conditions, during batch experiments performed with microorganisms coming from an activated sludge system. © 1997 John Wiley & Sons, Inc. Biotechnol Bioeng 53: 243-252, 1997.
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  • 28
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    Biotechnology and Bioengineering 53 (1997), S. 470-477 
    ISSN: 0006-3592
    Keywords: fluidized bed bioreactor ; recombinant ; yeast ; kinetics ; modeling ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Continuous production of a recombinant murine granulocyte-macrophage colony-stimulating factor (GM-CSF) by Saccharomyces cerevisiae strain XV2181 (a/a, Trp 1) containing plasmid pαADH2 and immobilized on porous glass beads in a fluidized bed bioreactor was studied. Kinetic models for plasmid stability, cell growth, and protein production in the three-phase fluidized bed bioreactor were developed and used to study the effects of solid loading or cell immobilization on plasmid stability and recombinant protein production. With increasing cell immobilization or solid loading in the bioreactor, plasmid stability and protein production improved significantly. The improvements could be attributed to the decreased θ value, which is the plasmid loss probability during cell division and is an indication of segregational instability of the recombinant cell, and the increased α value, which is the ratio of the specific growth rate of a plasmid-carrying cell to that of a plasmid-free cell and is indicative of competitive stability of the recombinant cell culture. θ decreased from 0.552 to 0.042 and α increased from 0.351 to 0.991 when solid loading in the bioreactor was increased from 5% (v/v) to 33%. The model simulation also showed that the specific growth rate of cells in the bioreactor was lower at higher solid loading. This indicated that there was significant mass transfer limitation, particularly for oxygen transfer, when the total cell density in the bioreactor was high at high solid loading. © 1997 John Wiley & Sons, Inc. Biotechnol Bioeng 53: 470-477, 1997.
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  • 29
    ISSN: 0006-3592
    Keywords: Agrobacterium radiobacter ; D-hydantoinase ; modeling ; factorial design ; amino acids ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: D-Hydantoinases (E.C.3.5.2.2) are commercially valuable enzymes involved in the production of D-amino acids. However, commercial exploitation of the biological process is rare, mainly because sufficient details are not available on the efficient production of these enzymes by microorganisms. In the present study, Agrobacterium radiobacter was used as the source of D-hydantoinase and its production was optimized with inexpensive carbon and nitrogen sources. The four media components selected to study their effect on biomass and/or enzyme activities were molasses, ammonium nitrate, sodium di-hydrogen orthophosphate, and manganese chloride. With the use of an empirical modeling technique (response surface method), we have optimized both biomass and enzyme production in this organism, with a minimal number of batches. Experiments were performed with optimized media components to validate the model. The maximum level of enzyme and biomass obtained was 35 U/mL and 1.69 mg/mL, respectively. © 1997 John Wiley & Sons, Inc. Biotechnol Bioeng 55: 148-154, 1997.
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  • 30
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    Biotechnology and Bioengineering 46 (1995), S. 599-609 
    ISSN: 0006-3592
    Keywords: Phanerochaete chrysosporium ; white rot fungus ; chlorophenol ; optimization ; modeling ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The biodegradation of 2,4,6-trichlorophenol and 2,4,5-trichlorophenol by the white rot fungus Phanerochaete chrysosporium was studied in batch and continuous reactor systems. Experiments were conducted in shake flasks as well as in packed-bed reactors in which the fungus was immobilized. The degradation rates in the packed-bed reactors were found to be two orders of magnitude greater than those obtained in the shake flasks in which the fungus was just suspended. The degradation rate was found to be influenced by the concentrations of the carbon and nitrogen sources, pH, and fluid shear stress. Optimal ranges of these parameters to maximize biodegradation were determined. A mathematical model was developed in which the degradation process was assumed to consist of two sequential reaction steps, the first catalyzed by an extracellular enzyme system and the second requiring the presence of the mycelium. The deactivation of the extracellular enzyme system was also accounted for in the model. The Michaelis-Menten and the enzyme deactivation parameters were determined independently. Good agreement between the experimental data and the results produced by the regression was found. © 1995 John Wiley & Sons, Inc.
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    Biotechnology and Bioengineering 47 (1995), S. 121-130 
    ISSN: 0006-3592
    Keywords: α-lactalbumin ; whey ; isoelectric precipitation ; calcium complexation ; modeling ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The selective precipitation of α-lactalbumin (α-LA) at a pH around its isoelectric point (4.2) under heat treatment is the basis for a fractionation process of whey proteins. As precipitation is a phenomenon dependent on the protein hydrophobicity, and as the release of the tightly bound calcium occurring at pH around 4 modifies the α-LA hydrophobicity, the specific role of calcium on isoelectric precipitation is investigated. A study of the extent of α-LA precipitation in a whey protein concentrate under various operating conditions of pH, temperature, protein concentration, and calcium content is presented. We propose a mechanism for this phenomenon as a combination of a complexation equilibrium and of an irreversible precipitation, to account for the influence of temperature, α-LA concentration total ionic content, and calcium concentration, and also to estimate the complexation equilibrium constant. © 1995 John Wiley & Sons, Inc.
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  • 32
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    Biotechnology and Bioengineering 56 (1997), S. 492-501 
    ISSN: 0006-3592
    Keywords: cometabolism ; methanotroph ; modeling ; trichloroethylene ; inhibition ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A model for cometabolism is verified experimentally for a defined methanotrophic mixed culture. The model includes the effects of cell growth, endogenous cell decay, product toxicity, and competitive inhibition with the assumption that cometabolic transformation rates are enhanced by reducing power obtained from oxidation of growth substrates. A theoretical transformation yield is used to quantify the enhancement resulting from growth substrate oxidation. A systematic method for evaluating model parameters independently is described. The applicability of the model is evaluated by comparing experimental data for methanotrophic cometabolism of TCE with model predictions from independently measured model parameters. Propagation of errors is used to quantify errors in parameter estimates and in the final prediction. The model successfully predicts TCE transformation and methane utilization for a wide range of concentrations of TCE (0.5 to 9 mg/L) and methane (0.05 to 6 mg/L). © 1997 John Wiley & Sons, Inc. Biotechnol Bioeng 56: 492-501, 1997.
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  • 33
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    Biotechnology and Bioengineering 57 (1998), S. 330-341 
    ISSN: 0006-3592
    Keywords: brewers' yeast ; collision theory ; flocculation ; modeling ; surface erosion ; floc splitting ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Flocculation of yeast cells occurs during the fermentation of beer. Partway through the fermentation the cells become flocculent and start to form flocs. If the environmental conditions, such as medium composition and fluid velocities in the tank, are optimal, the flocs will grow in size large enough to settle. After settling of the main part of the yeast the green beer is left, containing only a small amount of yeast necessary for rest conversions during the next process step, the lagering. The physical process of flocculation is a dynamic equilibrium of floc formation and floc breakup resulting in a bimodal size distribution containing single cells and flocs.The floc size distribution and the single cell amount were measured under the different conditions that occur during full scale fermentation. Influences on flocculation such as floc strength, specific power input, and total number of yeast cells in suspension were studied. A flocculation model was developed, and the measured data used for validation. Yeast floc formation can be described with the collision theory assuming a constant collision efficiency. The breakup of flocs appears to occur mainly via two mechanisms, the splitting of flocs and the erosion of yeast cells from the floc surface. The splitting rate determines the average floc size and the erosion rate determines the number of single cells. Regarding the size of the flocs with respect to the scale of turbulence, only the viscous subrange needs to be considered. With the model, the floc size distribution and the number of single cells can be predicted at a certain point during the fermentation. For this, the bond strength between the cells, the fractal dimension of the yeast, the specific power input in the tank and the number of yeast cells that are in suspension in the tank have to be known. © 1998 John Wiley & Sons, Inc. Biotechnol Bioeng 57: 330-341, 1998.
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  • 34
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    Biotechnology and Bioengineering 57 (1998), S. 571-582 
    ISSN: 0006-3592
    Keywords: TGFα ; autocrine ; modeling ; cell density ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: We have developed an experimental system for testing mathematical model predictions concerning escape of autocrine ligands into the extracellular bulk medium. This system employs anti-receptor blocking antibodies against the epidermal growth factor receptor (EGFR)/transforming growth factor alpha (TGFα) receptor/ligand pair. TGFα was expressed under the control of a tetracycline-repressed promoter, together with a constitutively expressed human EGFR in B82 mouse fibroblast cells. This expression system allowed us to vary TGFα synthesis rates over a roughly 300-fold range by adjusting tetracycline concentration. TGFα accumulation in the extracellular bulk medium was then measured as a function of cell density, TGFα synthesis rate, and anti-EGFR blocking antibody concentration. Consistent with model predictions, amounts of ligand in the medium on a per cell basis were found to diminish as cell density was increased but with reduced dependence on cell density at higher ligand synthesis rates. Similarly consistent with model predictions, higher ligand synthesis rates also decreased the effect of anti-receptor blocking antibodies. Our investigation has established that we can successfully analyze and understand autocrine ligand secretion behavior from the basis of our theoretical model. ©1998 John Wiley & Sons, Inc. Biotechnol Bioeng 57: 571-582, 1998.
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  • 35
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    Biotechnology and Bioengineering 54 (1997), S. 122-130 
    ISSN: 0006-3592
    Keywords: modeling ; layered anaerobic granular biofilms ; biofilm detachment model ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A model that portrays substrate profiles in a steady-state multispecies granular biofilm is developed and coupled with a biofilm detachment model. The model accounts for glucose, propionate, hydrogen, and acetate transformations performed by three bacterial trophic groups: acidogens, syntrophic bacterial consortia, and methanogens. This model adequately describes the phenomenon of propionate degradation under thermodynamically unfavorable bulk hydrogen concentrations. Also suggested is the superiority of the layered biofilm structure over homogeneous distribution of the trophic groups for anaerobic degradation of organic compounds. Furthermore, model analysis suggests that with increasing bulk glucose concentration biofilm thickness reaches a maximum that is then followed by biofilm disintegration. These results may have an important impact on the design and control of upflow anaerobic sludge bed reactors. © 1997 John Wiley & Sons, Inc. Biotechnol Bioeng 54: 122-130, 1997.
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  • 36
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    Biotechnology and Bioengineering 55 (1997), S. 447-454 
    ISSN: 0006-3592
    Keywords: plasmid stability ; protein production ; proteinase A ; Saccharomyces cerevisiae ; modeling ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Overexpression of the homologous protein proteinase A (PrA) in Saccharomyces cerevisiae has been achieved by inserting the PrA gene (PEP4) with its own promoter on a 2μ multicopy plasmid. With this system the specific PrA production rate was found to be described well by a linear function of the oxidative glucose metabolism, the reductive glucose metabolism, and the oxidative ethanol metabolism, with a significant lower yield resulting from the reductive glucose metabolism compared with the oxidative glucose metabolism. To describe the experimental data, a simple mathematical model has been set up. The model is based on an assumption of a limited respiratory capacity as suggested by Sonnleitner and Käppeli but extended to describe production of an extracellular protein. The model predicts correctly the critical dilution rate to be between 0.15 and 0.16 h-1, the decrease in the biomass yield above the critical dilution rate, and the production of proteinase A at different dilution rates. Both the experimental data and model simulations suggest that the optimum operating conditions for protein production is just at the critical dilution rate. © 1997 John Wiley & Sons, Inc. Biotechnol Bioeng 55: 447-454, 1997.
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  • 37
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    Biotechnology and Bioengineering 58 (1998), S. 101-116 
    ISSN: 0006-3592
    Keywords: biofilm ; structure ; shape ; surface ; cellular automata ; discrete ; modeling ; roughness ; fractal ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A hybrid differential-discrete mathematical model has been used to simulate biofilm structures (surface shape, roughness, porosity) as a result of microbial growth in different environmental conditions. In this study, quantitative two- and three-dimensional models were evaluated by introducing statistical measures to characterize the complete biofilm structure, both the surface structure and volume structure. The surface enlargement, coefficient of roughness, fractal dimension of surface, biofilm compactness, and solids hold-up were found to be good measures of biofilm structure complexity. Among many possible factors affecting the biofilm structure, the influence of biomass growth in relation to the diffusive substrate transport was investigated. Porous biofilms, with many channels and voids between the “finger-like” or “mushroom” outgrowth, were obtained in a substrate-transport-limited regime. Conversely, compact and dense biofilms occurred in systems limited by the biomass growth rate and not by the substrate transfer rate. The surface complexity measures (enlargement, roughness, fractal dimension) all increased with increased transport limitation, whereas the volume measures (compactness, solid hold-up) decreased, showing the change from a compact and dense to a highly porous and open biofilm. © 1998 John Wiley & Sons, Inc. Biotechnol Bioeng 58:101-116, 1998.
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  • 38
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    Biotechnology and Bioengineering 57 (1998), S. 718-731 
    ISSN: 0006-3592
    Keywords: biofilm ; modeling ; reaction-diffusion-growth ; cellular automata ; immobilized cells ; structure ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The theoretical basis and quantitative evaluation of a new approach for modeling biofilm growth are presented here. Soluble components (e.g., substrates) are represented in a continuous field, whereas discrete mapping is used for solid components (e.g., biomass). The spatial distribution of substrate is calculated by applying relaxation methods to the reaction-diffusion mass balance. A biomass density map is determined from direct integration in each grid cell of a substrate-limited growth equation. Spreading and distribution of biomass is modeled by a discrete cellular automaton algorithm. The ability of this model to represent diffusion-reaction-microbial growth systems was tested for a well-characterized system: immobilized cells growing in spherical gel beads. Good quantitative agreement with data for global oxygen consumption rate was found. The calculated concentration profiles of substrate and biomass in gel beads corresponded to those measured. Moreover, it was possible, using the discrete spreading algorithm, to predict the spatial two- and three-dimensional distribution of microorganisms in relation to, for example, substrate flux and inoculation density. The new technique looks promising for modeling diffusion-reaction-microbial growth processes in heterogeneous systems as they occur in biofilms. © 1998 John Wiley & Sons, Inc. Biotechnol Bioeng 57: 718-731, 1998
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  • 39
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    Biotechnology and Bioengineering 55 (1997), S. 408-418 
    ISSN: 0006-3592
    Keywords: lead absorption ; microorganisms ; modeling ; Anabaena cylindrica ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: The ability of microorganisms to selectively adsorb various heavy metal ions has been recognized for over a decade. We have investigated the biosorption of lead by an active culture of the cyanobacterium Anabaena cylindrica. Energy dispersive X-ray microanalysis was used to evaluate the different uptake mechanisms in the various subcellular regions. Three were identified: a very fast adsorption mechanism in the cell envelope; a time-dependent deposition reaction on the cell surface; and an adsorption mechanism, also time dependent, on the polyphosphate body inside the cell. Atomic absorption spectrometry was then used to quantify the changes with time of bulk fluid concentrations of lead solutions exposed to cyanobacteria. A mass transfer kinetic model was developed which quantitatively predicts the concentration of lead in cells of Anabaena cylindrica as a function of spatial dimensions and time. The model predictions are consistent with a pattern, documented in literature and confirmed by our own experimental evidence, of a very fast uptake in the cell envelope and then a longer uptake period inside the cell. Our experimental evidence also revealed a time-dependent uptake mechanism on the surface of the cells, which is included in the model. © 1997 John Wiley & Sons, Inc. Biotechnol Bioeng 55: 408-418, 1997.
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  • 40
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    Biotechnology and Bioengineering 59 (1998), S. 732-746 
    ISSN: 0006-3592
    Keywords: Desulfovibrio vulgaris ; hydrogen cycling ; kinetics ; thermodynamics ; modeling ; anaerobic ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A unified model for the growth of Desulfovibrio vulgaris under different environmental conditions is presented. The model assumes the existence of two electron transport mechanisms functioning simultaneously. One mechanism results in the evolution and consumption of hydrogen, as in the hydrogen-cycling model. The second mechanism assumes a direct transport of electrons from the donor to the acceptor, without the participation of H2. A combination of kinetic and thermodynamic conditions control the flow of electrons through each pathway. The model was calibrated using batch experiments with D. vulgaris grown on lactate, in the presence and absence of sulfate, and was verified using additional batch experiments under different conditions. The model captured the general trends of consumption of substrates and accumulation of products, including the transient accumulation and consumption of H2. Furthermore, the model estimated that 48% of the electrons transported from lactate to sulfate involved H2 production, indicating that hydrogen cycling is a fundamental process in D. vulgaris. The presence of simultaneous electron transport mechanisms might provide D. vulgaris with important ecological advantages, because it facilitates a rapid response to changes in environmental conditions. This model increases our ability to study the microbial ecology of anaerobic environments and the role of Desulfovibrio species in a variety of environments. © 1998 John Wiley & Sons, Inc. Biotechnol Bioeng 59:732-746, 1998.
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  • 41
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    Biotechnology and Bioengineering 60 (1998), S. 292-300 
    ISSN: 0006-3592
    Keywords: enzyme inactivation ; modeling ; avocado ; polyphenoloxidase ; pressure stability ; thermostability ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Irreversible combined pressure-temperature inactivation of the food quality related enzyme polyphenoloxidase was investigated. Inactivation rate constants (k) were obtained for about one hundred combinations of constant pressure (0.1-900 MPa) and temperature (25-77.5°C). According to the Eyring and Arrhenius equation, activation volumes and activation energies, respectively, representing pressure and temperature dependence of the inactivation rate constant, were calculated for all temperatures and pressures studied. In this way, temperature and pressure dependence of activation volume and activation energy, respectively, could be considered. Moreover, for the first time, a mathematical model describing the inactivation rate constant of a food quality-related enzyme as a function of pressure and temperature is formulated. Such pressure-temperature inactivation models for food quality-related aspects (e.g., the spoilage enzyme polyphenoloxidase) form the engineering basis for design, evaluation, and optimization of new preservation processes based on the combined effect of temperature and pressure. Furthermore, the generated methodology can be used to develop analogous kinetic models for microbiological aspects, which are needed from a safety and legislative point of view, and other quality aspects, e.g., nutritional factors, with a view of optimal quality and consumer acceptance. © 1998 John Wiley & Sons, Inc. Biotechnol Bioeng 60: 292-300, 1998.
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  • 42
    ISSN: 0006-3592
    Keywords: cutinase ; aqueous two-phase systems ; partition ; modeling ; electrostatics ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A model for the prediction of protein partition coefficients in aqueous two-phase systems has been developed. This model accounts for both charge-independent and electrostatic effects. The determination of nonelectrostatic effects was based on the model of Eiteman and Gainer for uncharged solutes while the electrostatic contribution was computed using TITRA, a program that uses a continuum electrostatic model to treat charge interactions in proteins and considers the effect of pH and ionic strength. The partition coefficients of Fusarium solani pisi recombinant cutinase have been satisfactorily predicted in polyethylene glycol (PEG) 1000 and phosphate aqueous two-phase systems at a pH range of 6.0-9.0. The model failed to predict the enzyme partitioning behavior at pH 4.5. © 1997 John Wiley & Sons, Inc. Biotechnol Bioeng 56: 248-257, 1997.
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